MMs02218453 MOE2007 2D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8778 -1.2163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2634 -2.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3701 -1.0643 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2479 -2.2806 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5585 -1.1215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7798 -3.7057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9906 -4.5912 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1861 -5.8573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7421 -5.8894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2069 -3.7134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7479 -2.2854 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9070 -2.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6334 -1.0747 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1247 -1.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7304 -2.6085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0102 -0.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9731 0.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7023 0.9731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9731 -0.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6851 -3.2141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1765 -4.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8036 -4.7546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3047 -3.2288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9788 -0.7339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7187 0.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0417 0.6829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 M END